3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
TL;DR: 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole (CAS 72808-70-9) is a chemical compound with molecular formula C15H18N2 and molecular weight 226.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole
Also Known As: 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole, ChemDiv3_011215, IDI1_028773, 3-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole, BRD-K76700848-001-01-3
| Molecular Formula | C15H18N2 |
|---|---|
| Molecular Weight | 226.15 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 19.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.147 |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 72808-70-9 |
|---|---|
| SMILES | CCN1CCC(=CC1)C2=CNC3=CC=CC=C32 |
| InChIKey | AUPFODUFUNPAOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole (CAS 72808-70-9), with molecular formula C15H18N2 and molecular weight 226.15 g/mol. IUPAC: 3-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole.
Chemical Property Profile of 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
Property Insights of 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole. With a topological polar surface area (TPSA) of 19.0 Ų, 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole?
The CAS number of 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole is 72808-70-9.
What is the molecular formula of 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole?
The molecular formula of 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole is C15H18N2.
What is the molecular weight of 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole?
The molecular weight of 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole is 226.15 g/mol.
Where can I buy 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole?
You can request a quote for 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.